Palisadin A
(5aS,7S,9aS,10aR)-7-bromo-6,6,9a-trimethyl-1,3,5,5a,7,8,9,10a-octahydrofuro[3,4-b][1]benzoxepine
Also Known As: Palisadin A|AI3-37156|Furo(3,4-b)(1)benzoxepin, 7-bromo-1,3,3a,4a,5,6,7,8,8a,9-decahydro-4a,8,8-trimethyl-, (3aR,4aS,7S,8aS)-|(3aR,4aS,7S,8aS)-7-Bromo-1,3,3a,4a,5,6,7,8,8a,9-decahydro-4a,8,8-trimethylfuro[3,4-b][1]benzoxepin|(5aS,7S,9aS,10aR)-7-bromo-6,6,9a-trimethyl-1,3,5,5a,7,8,9,10a-octahydrofuro[3,4-b][1]benzoxepine|(1S,3R,10S,12S)-12-bromo-1,11,11-trimethyl-2,5-dioxatricyclo[8.4.0.03,7]tetradec-7-ene|(3aR)-7alpha-Bromo-1,3,3abeta,4aalpha,5,6,7,8,8abeta,9-decahydro-4a,8,8-trimethylfuro[3,4-b][1]benzoxepin|(3aR,4aS,7S,8aS)-7-Bromo-4a,8,8-trimethyl-1,3,3a,4a,5,6,7,8,8a,9-decahydrofuro[3,4-b][1]benzoxepine|(5aS,7S,9aS,10aR)-7-bromo-6,6,9a-trimethyl-1,3,5,5a,7,8,9,10a-octahydrofuro(3,4-b)(1)benzoxepine
| Molecular Formula | C15H23BrO2 |
|---|---|
| Molecular Weight | 314.08813 g/mol |
| LogP | 2.8 |
| Topological Polar Surface Area | 18.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 314.08813 |
| Monoisotopic Mass | 314.08813 |
| Heavy Atoms | 18 |
| Complexity | 377.0 |
Chemical Identifiers
| CAS Number | 77249-86-6 |
|---|---|
| SMILES | C[C@]12CC[C@@H](C([C@@H]1CC=C3COC[C@@H]3O2)(C)C)Br |
| InChIKey | DDKCCVWYONKPQR-ABHRYQDASA-N |
Product Overview
Palisadin A (CAS 77249-86-6), with molecular formula C15H23BrO2 and molecular weight 314.08813 g/mol. IUPAC: (5aS,7S,9aS,10aR)-7-bromo-6,6,9a-trimethyl-1,3,5,5a,7,8,9,10a-octahydrofuro[3,4-b][1]benzoxepine.
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